N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide

C9H12N4O4 — CID 79375686

IUPACN-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide
SMILESCOc1nc(C)cc(=O)n1CC(=O)NC(N)=O
InChIInChI=1S/C9H12N4O4/c1-5-3-7(15)13(9(11-5)17-2)4-6(14)12-8(10)16/h3H,4H2,1-2H3,(H3,10,12,14,16)
InChIKeyXQDXVAVRWABUCZ-UHFFFAOYSA-N
MW240.22 g/mol
LogP-1.24
Rot. Bonds3

About N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide

N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide (PubChem CID 79375686) has the molecular formula C9H12N4O4 and a molecular weight of 240.22 g/mol. Its IUPAC name is N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide
PubChem CID79375686
Molecular FormulaC9H12N4O4
Molecular Weight240.22 g/mol
Exact Mass240.09
IUPAC NameN-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide
SMILESCOc1nc(C)cc(=O)n1CC(=O)NC(N)=O
InChIInChI=1S/C9H12N4O4/c1-5-3-7(15)13(9(11-5)17-2)4-6(14)12-8(10)16/h3H,4H2,1-2H3,(H3,10,12,14,16)
InChIKeyXQDXVAVRWABUCZ-UHFFFAOYSA-N
XLogP-1.24
TPSA116.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 5-1.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 4-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)-3-oxobutanoate
CID 79375094
2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)-N-(4-methylphenyl)acetamide
CID 79370542
2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)-N-(3-methylbutyl)acetamide
CID 79375771
ethyl 5-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)-4-oxopentanoate
CID 103484799
3-(3,3-dimethyl-2-oxobutyl)-2-methoxy-6-methylpyrimidin-4-one
CID 79374027
2-methoxy-6-methyl-3-phenacylpyrimidin-4-one
CID 79374029
3-[2-(4-chlorophenyl)-2-oxoethyl]-2-methoxy-6-methylpyrimidin-4-one
CID 79374810
3-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)propanoic acid
CID 79366215
1-[2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)ethyl]triazole-4-carbohydrazide
CID 79371593
3-[2-(2,5-difluorophenyl)-2-oxoethyl]-2-methoxy-6-methylpyrimidin-4-one
CID 79370478
2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetonitrile
CID 79367231
5-[(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)methyl]furan-2-carbohydrazide
CID 79374701

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide (CID 79375686) is N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide is COc1nc(C)cc(=O)n1CC(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
The InChIKey is XQDXVAVRWABUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O4/c1-5-3-7(15)13(9(11-5)17-2)4-6(14)12-8(10)16/h3H,4H2,1-2H3,(H3,10,12,14,16).
What are the key properties of N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide?
N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide has a molecular weight of 240.22 g/mol, XLogP of -1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 79375686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).